5-amino-1-pentylpiperidin-2-one

C10H20N2O — CID 64977965

IUPAC5-amino-1-pentylpiperidin-2-one
SMILESCCCCCN1CC(N)CCC1=O
InChIInChI=1S/C10H20N2O/c1-2-3-4-7-12-8-9(11)5-6-10(12)13/h9H,2-8,11H2,1H3
InChIKeyCEMDKTSYQUPGBP-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.13
Rot. Bonds4

About 5-amino-1-pentylpiperidin-2-one

5-amino-1-pentylpiperidin-2-one (PubChem CID 64977965) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 5-amino-1-pentylpiperidin-2-one.

Molecular Properties

Compound Name5-amino-1-pentylpiperidin-2-one
PubChem CID64977965
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name5-amino-1-pentylpiperidin-2-one
SMILESCCCCCN1CC(N)CCC1=O
InChIInChI=1S/C10H20N2O/c1-2-3-4-7-12-8-9(11)5-6-10(12)13/h9H,2-8,11H2,1H3
InChIKeyCEMDKTSYQUPGBP-UHFFFAOYSA-N
XLogP1.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-1-dodecylpiperidin-2-one
CID 64977984
5-amino-1-butylpiperidin-2-one
CID 64978058
5-amino-1-(4-methoxybutyl)piperidin-2-one
CID 104650472
6-oxo-1-pentylpiperidine-3-carboxylic acid
CID 62230465
1,5-dibutylpiperidin-2-one
CID 139951277
5-amino-1-(3,3-dimethylbutyl)piperidin-2-one
CID 64977979
6-oxo-1-tetradecylpiperidine-3-carboxylic acid
CID 123215271
1-pentadecyl-5-propan-2-ylpiperidin-2-one
CID 166871927
5-amino-1-(2-hydroxyethyl)piperidin-2-one;hydrochloride
CID 69008245
1-butyl-5-(2-methylpropyl)piperidin-2-one
CID 139951244
1-pentadecyl-5-(propan-2-ylamino)piperidin-2-one
CID 167356479
1-butyl-5-propan-2-ylpiperidin-2-one
CID 139951242

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-pentylpiperidin-2-one?
The IUPAC name of 5-amino-1-pentylpiperidin-2-one (CID 64977965) is 5-amino-1-pentylpiperidin-2-one.
What is the SMILES notation for 5-amino-1-pentylpiperidin-2-one?
The canonical SMILES for 5-amino-1-pentylpiperidin-2-one is CCCCCN1CC(N)CCC1=O.
What is the InChIKey of 5-amino-1-pentylpiperidin-2-one?
The InChIKey is CEMDKTSYQUPGBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-3-4-7-12-8-9(11)5-6-10(12)13/h9H,2-8,11H2,1H3.
What are the key properties of 5-amino-1-pentylpiperidin-2-one?
5-amino-1-pentylpiperidin-2-one has a molecular weight of 184.28 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-pentylpiperidin-2-one is sourced from PubChem (CID 64977965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).